CDK 1030232201 36 40 0 0 0 0 0 0 0 0999 V2000 3.5724 0.8250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5724 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8579 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2868 -0.4125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.8579 -1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1434 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2868 -1.2375 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0013 0.0000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2868 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5724 -1.6500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4290 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0013 -1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2868 -2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7158 -0.4125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.0013 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7144 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7158 -1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4303 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7158 1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7144 0.8250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.4125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.4303 0.8250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7144 0.0000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0000 -1.2375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.7144 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1447 1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3020 0.7144 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4290 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1269 0.7144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7144 -1.6500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7144 -1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4290 -1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7144 -2.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7144 -2.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -2.8875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0000 -3.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 4 2 1 0 0 0 0 3 5 2 0 0 0 0 3 6 1 0 0 0 0 7 4 1 0 0 0 0 8 4 1 0 0 0 0 4 9 1 6 0 0 0 5 10 1 0 0 0 0 6 11 2 0 0 0 0 7 12 1 0 0 0 0 7 13 1 1 0 0 0 14 8 1 0 0 0 0 8 15 1 6 0 0 0 11 16 1 0 0 0 0 12 17 2 0 0 0 0 14 18 1 1 0 0 0 15 19 1 0 0 0 0 16 20 2 0 0 0 0 21 16 1 0 0 0 0 22 18 1 0 0 0 0 23 21 1 0 0 0 0 24 21 1 0 0 0 0 21 25 1 6 0 0 0 22 26 1 6 0 0 0 23 27 1 6 0 0 0 23 28 1 0 0 0 0 23 29 1 0 0 0 0 30 24 1 0 0 0 0 24 31 1 1 0 0 0 28 32 2 0 0 0 0 30 33 1 6 0 0 0 31 34 1 0 0 0 0 35 33 1 0 0 0 0 35 36 1 1 0 0 0 7 10 1 0 0 0 0 14 17 1 0 0 0 0 19 22 1 0 0 0 0 30 32 1 0 0 0 0 34 35 1 0 0 0 0 M END > CHEBI:213721 > Subnudatone A > 2 > (4aS,6aS,8S,10aR,10bS)-2-[(E)-3-[(1S,2S,4aR,6R,8aS)-2-hydroxy-1,2,6-trimethyl-4a,5,6,7,8,8a-hexahydronaphthalen-1-yl]-3-oxoprop-1-enyl]-4a,8,10b-trimethyl-6a,7,8,9,10,10a-hexahydrobenzo[]chromen-1-one > C32H44O4 > 492.700 > 492.32396 > 0 > O=C1C(=CO[C@@]2([C@@]1([C@H]3[C@@H](C[C@@H](C)CC3)C=C2)C)C)/C=C/C(=O)[C@@]4([C@@](O)(C=C[C@@H]5[C@@H]4CC[C@H](C5)C)C)C > InChI=1S/C32H44O4/c1-20-7-10-25-22(17-20)13-15-29(3,35)31(25,5)27(33)12-9-24-19-36-30(4)16-14-23-18-21(2)8-11-26(23)32(30,6)28(24)34/h9,12-16,19-23,25-26,35H,7-8,10-11,17-18H2,1-6H3/b12-9+/t20-,21+,22+,23-,25+,26-,29+,30+,31-,32-/m1/s1 > KFXNXODFQUQQGW-PYIUQNFNSA-N $$$$